%chk=000189931.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189931

0 1
P -1.377409 0.042376 1.099214
O 0.148283 -0.141933 1.636447
O -1.190249 1.317167 0.072707
O -1.506081 -1.232134 0.064541
O -2.426625 0.168366 2.124056
N 3.602874 -0.442681 0.478082
C 4.151043 0.937797 0.262091
C 4.673897 -1.384878 0.943281
C 5.260540 0.895562 -0.801668
C 5.792988 -1.458373 -0.109389
C 6.379608 -0.069800 -0.391780
C 2.456416 -0.415421 1.439574
C 1.177164 -0.273890 0.599820
C -2.259255 2.301104 0.065385
C -2.757441 -1.970159 0.101054
C -3.146723 2.031084 -1.150466
C -3.592350 -1.540012 -1.105901
C -4.163794 3.148921 -1.341392
C -4.845056 -2.396920 -1.235103
H 3.318248 1.582718 -0.093316
H 4.540424 1.395687 1.196925
H 5.099491 -1.098303 1.928743
H 4.212821 -2.389610 1.062916
H 4.827851 0.573328 -1.770276
H 5.662808 1.912124 -0.960274
H 6.581886 -2.150739 0.235139
H 5.385213 -1.886893 -1.047260
H 7.140561 -0.132962 -1.191238
H 6.904566 0.312403 0.503808
H 2.504128 0.403802 2.189542
H 2.398059 -1.355113 2.030318
H 1.181977 0.632929 -0.033242
H 0.977277 -1.175381 -0.009808
H -1.700220 3.253183 -0.031807
H -2.827654 2.305275 1.016860
H -3.294558 -1.835345 1.061167
H -2.414556 -3.020670 0.016090
H -3.670339 1.050719 -1.040926
H -2.509016 1.922018 -2.051795
H -2.972331 -1.609681 -2.023254
H -3.870946 -0.461882 -1.021081
H -4.802596 2.955519 -2.211826
H -3.678962 4.118803 -1.505329
H -4.823762 3.251818 -0.471048
H -5.445096 -2.089335 -2.100199
H -5.487179 -2.315420 -0.349249
H -4.602025 -3.457670 -1.370836


%chk=000189931-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189931

0 1
P -1.610203 0.361637 0.545111
O -0.114260 -0.206067 1.170261
O -1.148167 1.815080 -0.251502
O -1.936815 -0.638453 -0.834882
O -2.747137 0.462696 1.646364
N 3.547860 -0.535240 0.498608
C 4.155626 0.820067 0.528623
C 4.525241 -1.580076 0.897033
C 5.368095 0.905403 -0.420794
C 5.747004 -1.572926 -0.044099
C 6.413144 -0.177819 -0.067916
C 2.264651 -0.607577 1.235949
C 1.115553 -0.166935 0.318712
C -2.159542 2.912442 -0.344286
C -2.454367 -2.022915 -0.598353
C -3.160531 2.678477 -1.482395
C -3.971442 -2.039434 -0.367951
C -4.131010 3.873915 -1.616947
C -4.496089 -3.487517 -0.239782
H 3.391713 1.562201 0.232659
H 4.485307 1.083648 1.569172
H 4.877073 -1.428619 1.952372
H 4.020703 -2.563278 0.855334
H 5.017595 0.758654 -1.460639
H 5.815534 1.915975 -0.355379
H 6.468821 -2.345405 0.284611
H 5.409420 -1.838895 -1.064529
H 7.250438 -0.159776 -0.790930
H 6.844118 0.039780 0.931693
H 2.257158 0.018016 2.159047
H 2.081971 -1.650937 1.550202
H 1.256563 0.859697 -0.062712
H 1.003724 -0.862218 -0.532172
H -1.541060 3.807056 -0.528766
H -2.674817 3.014016 0.630516
H -1.914619 -2.484254 0.253335
H -2.180212 -2.556203 -1.525378
H -3.731077 1.750595 -1.287141
H -2.604773 2.523370 -2.425361
H -4.464769 -1.530346 -1.217437
H -4.206462 -1.462026 0.544981
H -4.852533 3.700579 -2.434795
H -3.588666 4.811955 -1.840006
H -4.708723 4.028316 -0.686471
H -5.587972 -3.491934 -0.074978
H -4.027282 -4.011262 0.614431
H -4.290885 -4.075967 -1.154118


